Carbonochloridic acid, octyl ester


Chemical Name: Carbonochloridic acid, octyl ester
CAS Number: 7452-59-7
Product Number: AG003OTT(AGN-PC-0JLTLB)
Synonyms:
MDL No:
Molecular Formula: C9H17ClO2
Molecular Weight: 192.68308

Identification/Properties


Properties
BP:
90-91 °C (11 mmHg)
Storage:
2-8℃;Keep in dry area;
Form:
Liquid
Refractive Index:
1.43-1.432
Computed Properties
Molecular Weight:
192.683g/mol
XLogP3:
4.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
8
Exact Mass:
192.092g/mol
Monoisotopic Mass:
192.092g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
115
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3277
Hazard Statements:
H300+H310+H330-H314-H227-H290
Precautionary Statements:
P501-P260-P270-P262-P210-P234-P271-P264-P280-P284-P370+P378-P390-P361+P364-P303+P361+P353-P301+P330+P331-P301+P310+P330-P304+P340+P310-P305+P351+P338+P310-P403+P233-P403+P235-P406-P405
Class:
6.1,8
Packing Group:

NMR Spectrum


Other Analytical Data


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